Geometry & MOs

Info

ID:	24730
PubChem CID:	612782
Reduced:	OC30H48 (1)
Stoich.:	AB30C48 (1)
Weight, g/mol:	424.370516
ΔH_f, kcal/mol:	-117.49
Dipole, Da:	3.66
IP(EA), eV:	-9.03(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,6a,6b,8a,11,11,14b-octamethyl-2,4a,5,6,7,8,9,10,12,12a,14,14a-dodecahydro-1H-picen-3-one

Drug info:

PubChemData

Smile

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1)C)C)C

DOS

IR

Vibrations